Er3MgRh4
Alexandria ALEXAlex-ID: agm017331470 · Space group: I4/mmm (#139)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB3C4_344_spg139
Er2MgRh3 Er4MgRh5
2024-12-28 04:43:43
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm017331470).
Th. Cavignac, J. Schmidt, P.-P. De Breuck, A. Loew, T. F. T. Cerqueira, H.-C. Wang, A. Bochkarev, Y. Lysogorskiy, A. H. Romero, R. Drautz, S. Botti and M. A. L. Marques. AI-Driven expansion and application of the Alexandria database. J. Phys. Mater. 9, 025014 (2026). https://doi.org/10.1088/2515-7639/ae6620
@article{Cavignac2026Alexandria,
author = {Cavignac, Th{\'e}o and Schmidt, Jonathan and De Breuck, Pierre-Paul and Loew, Antoine
and Cerqueira, Tiago F. T. and Wang, Hai-Chen and Bochkarev, Anton
and Lysogorskiy, Yury and Romero, Aldo H. and Drautz, Ralf and Botti, Silvana
and Marques, Miguel A. L.},
title = {{AI}-Driven expansion and application of the {A}lexandria database},
journal = {Journal of Physics: Materials},
year = {2026},
volume = {9},
number = {2},
pages = {025014},
doi = {10.1088/2515-7639/ae6620},
url = {https://doi.org/10.1088/2515-7639/ae6620}
}
3D Crystal Structure Rendering
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# CIF generated by HEAS from Alexandria entry agm017331470
data_agm017331470
_cell_length_a 7.43904
_cell_length_b 7.43904
_cell_length_c 7.43904
_cell_angle_alpha 143.07440
_cell_angle_beta 143.07440
_cell_angle_gamma 53.21366
_cell_volume 147.66005
_symmetry_space_group_name_H-M 'P 1'
_symmetry_Int_Tables_number 1
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
Er1 Er 0.50000 0.50000 0.00000 1.00000
Er2 Er 0.24515 0.24515 0.00000 1.00000
Er3 Er 0.75485 0.75485 0.00000 1.00000
Mg1 Mg 0.00000 0.00000 0.00000 1.00000
Rh1 Rh 0.37680 0.87680 0.50000 1.00000
Rh2 Rh 0.62320 0.12320 0.50000 1.00000
Rh3 Rh 0.12320 0.62320 0.50000 1.00000
Rh4 Rh 0.87680 0.37680 0.50000 1.00000
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